SCHEMBL8871883

SCHEMBL8871883

Cn1c(Br)c(C#N)c(Br)c1C#N

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.39
GRIA4 P48058 1/20 0.35
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8872484 0.81 DYRK1A (0.41) DYRK1AGRIA4ATM
SCHEMBL8873272 0.81 DYRK1A (0.30) DYRK1A
SCHEMBL9564333 0.78 DYRK1A (0.44) DYRK1AGRIA4KDM4EMEN1MAPT
SCHEMBL279728 0.77 KDM4E (0.31) KDM4EMEN1MAPTKMT2AATM
SCHEMBL12507811 0.69 ALDH1A1 (0.36) KDM4EMEN1MAPTKMT2A
SCHEMBL279721 0.68 KDM4E (0.31) KDM4EMEN1MAPTKMT2AATM
SCHEMBL8911297 0.64
SCHEMBL8872151 0.64 DYRK1A (0.36) DYRK1AGRIA4KMT2A
SCHEMBL9120401 0.63 DYRK1A (0.32) DYRK1AKMT2AATM
SCHEMBL8872265 0.62 KDM4E (0.39) KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5702681-A ADMINISTERING A NITROPYRROLE OR A PYRROLE CARBONITRILE COMPOUND AMERICAN CYANAMID COMPANY (US) 1997-12-30 US disclosed
US-5665759-A ADMINISTERING A NITROPYRROLE OR PYRROLE CARBONITRILE COMPOUND AMERICAN CYANAMID COMPANY (US) 1997-09-09 US disclosed
EP-0372263-B1 Pyrrole carbonitrile and nitro-pyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID CO (US) 1995-02-15 EP disclosed
US-5371239-A Pyrrole nitrile or nitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1994-12-06 US disclosed
EP-0557732-A1 Methods and compositions for protecting animals against attack and infestation by helminth, acarid and anthropod endo- and ectoparasites AMERICAN CYANAMID COMPANY (US) 1993-09-01 EP disclosed
US-5204332-A PYRROLE CARBONITRILE AND NITROPYRROLE INSECTICIDAL AND ACARICIDAL AND MOLLUSCICIDAL AGENTS AMERICAN CYANAMID COMPANY (US) 1993-04-20 US disclosed
US-5162308-A Pyrrole carbonitrile and nitropyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1992-11-10 US disclosed
EP-0372263-A2 Pyrrole carbonitrile and nitro-pyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1990-06-13 EP disclosed